Global Safe Sequential Learning via Efficient Knowledge Transfer

Sequential learning methods such as active learning and Bayesian optimization select the most informative data to learn about a task. In many medical or engineering applications, the data selection is constrained by a priori unknown safety conditions. A promissing line of safe learning methods utilize Gaussian processes (GPs) to model the safety probability and perform data selection in areas with high safety confidence. However, accurate safety modeling requires prior knowledge or consumes data. In addition, the safety confidence centers around the given observations which leads to local exploration. As transferable source knowledge is often available in safety critical experiments, we propose to consider transfer safe sequential learning to accelerate the learning of safety. We further consider a pre-computation of source components to reduce the additional computational load that is introduced by incorporating source data. In this paper, we theoretically analyze the maximum explorable safe regions of conventional safe learning methods. Furthermore, we empirically demonstrate that our approach 1) learns a task with lower data consumption, 2) globally explores multiple disjoint safe regions under guidance of the source knowledge, and 3) operates with computation comparable to conventional safe learning methods.

Hybrid Modeling Design Patterns

Design patterns provide a systematic way to convey solutions to recurring modeling challenges. This paper introduces design patterns for hybrid modeling, an approach that combines modeling based on first principles with data-driven modeling techniques. While both approaches have complementary advantages there are often multiple ways to combine them into a hybrid model, and the appropriate solution will depend on the problem at hand. In this paper, we provide four base patterns that can serve as blueprints for combining data-driven components with domain knowledge into a hybrid approach. In addition, we also present two composition patterns that govern the combination of the base patterns into more complex hybrid models. Each design pattern is illustrated by typical use cases from application areas such as climate modeling, engineering, and physics.

Sampling-Free Probabilistic Deep State-Space Models

Many real-world dynamical systems can be described as State-Space Models (SSMs). In this formulation, each observation is emitted by a latent state, which follows first-order Markovian dynamics. A Probabilistic Deep SSM (ProDSSM) generalizes this framework to dynamical systems of unknown parametric form, where the transition and emission models are described by neural networks with uncertain weights. In this work, we propose the first deterministic inference algorithm for models of this type. Our framework allows efficient approximations for training and testing. We demonstrate in our experiments that our new method can be employed for a variety of tasks and enjoys a superior balance between predictive performance and computational budget.

Can you text what is happening? Integrating pre-trained language encoders into trajectory prediction models for autonomous driving

In autonomous driving tasks, scene understanding is the first step towards predicting the future behavior of the surrounding traffic participants. Yet, how to represent a given scene and extract its features are still open research questions. In this study, we propose a novel text-based representation of traffic scenes and process it with a pre-trained language encoder. First, we show that text-based representations, combined with classical rasterized image representations, lead to descriptive scene embeddings. Second, we benchmark our predictions on the nuScenes dataset and show significant improvements compared to baselines. Third, we show in an ablation study that a joint encoder of text and rasterized images outperforms the individual encoders confirming that both representations have their complementary strengths.

Cheap and Deterministic Inference for Deep State-Space Models of Interacting Dynamical Systems

Graph neural networks are often used to model interacting dynamical systems since they gracefully scale to systems with a varying and high number of agents. While there has been much progress made for deterministic interacting systems, modeling is much more challenging for stochastic systems in which one is interested in obtaining a predictive distribution over future trajectories. Existing methods are either computationally slow since they rely on Monte Carlo sampling or make simplifying assumptions such that the predictive distribution is unimodal. In this work, we present a deep state-space model which employs graph neural networks in order to model the underlying interacting dynamical system. The predictive distribution is multimodal and has the form of a Gaussian mixture model, where the moments of the Gaussian components can be computed via deterministic moment matching rules. Our moment matching scheme can be exploited for sample-free inference, leading to more efficient and stable training compared to Monte Carlo alternatives. Furthermore, we propose structured approximations to the covariance matrices of the Gaussian components in order to scale up to systems with many agents. We benchmark our novel framework on two challenging autonomous driving datasets. Both confirm the benefits of our method compared to state-of-the-art methods. We further demonstrate the usefulness of our individual contributions in a carefully designed ablation study and provide a detailed runtime analysis of our proposed covariance approximations. Finally, we empirically demonstrate the generalization ability of our method by evaluating its performance on unseen scenarios.

Combining Slow and Fast: Complementary Filtering for Dynamics Learning

Modeling an unknown dynamical system is crucial in order to predict the future behavior of the system. A standard approach is training recurrent models on measurement data. While these models typically provide exact short-term predictions, accumulating errors yield deteriorated long-term behavior. In contrast, models with reliable long-term predictions can often be obtained, either by training a robust but less detailed model, or by leveraging physics-based simulations. In both cases, inaccuracies in the models yield a lack of short-time details. Thus, different models with contrastive properties on different time horizons are available. This observation immediately raises the question: Can we obtain predictions that combine the best of both worlds? Inspired by sensor fusion tasks, we interpret the problem in the frequency domain and leverage classical methods from signal processing, in particular complementary filters. This filtering technique combines two signals by applying a high-pass filter to one signal, and low-pass filtering the other. Essentially, the high-pass filter extracts high-frequencies, whereas the low-pass filter extracts low frequencies. Applying this concept to dynamics model learning enables the construction of models that yield accurate long- and short-term predictions. Here, we propose two methods, one being purely learning-based and the other one being a hybrid model that requires an additional physics-based simulator.

Learning Interacting Dynamical Systems with Latent Gaussian Process ODEs

We study for the first time uncertainty-aware modeling of continuous-time dynamics of interacting objects. We introduce a new model that decomposes independent dynamics of single objects accurately from their interactions. By employing latent Gaussian process ordinary differential equations, our model infers both independent dynamics and their interactions with reliable uncertainty estimates. In our formulation, each object is represented as a graph node and interactions are modeled by accumulating the messages coming from neighboring objects. We show that efficient inference of such a complex network of variables is possible with modern variational sparse Gaussian process inference techniques. We empirically demonstrate that our model improves the reliability of long-term predictions over neural network based alternatives and it successfully handles missing dynamic or static information. Furthermore, we observe that only our model can successfully encapsulate independent dynamics and interaction information in distinct functions and show the benefit from this disentanglement in extrapolation scenarios.

Safe Active Learning for Multi-Output Gaussian Processes

Multi-output regression problems are commonly encountered in science and engineering. In particular, multi-output Gaussian processes have been emerged as a promising tool for modeling these complex systems since they can exploit the inherent correlations and provide reliable uncertainty estimates. In many applications, however, acquiring the data is expensive and safety concerns might arise (e.g. robotics, engineering). We propose a safe active learning approach for multi-output Gaussian process regression. This approach queries the most informative data or output taking the relatedness between the regressors and safety constraints into account. We prove the effectiveness of our approach by providing theoretical analysis and by demonstrating empirical results on simulated datasets and on a real-world engineering dataset. On all datasets, our approach shows improved convergence compared to its competitors.

Traversing Time with Multi-Resolution Gaussian Process State-Space Models

Gaussian Process state-space models capture complex temporal dependencies in a principled manner by placing a Gaussian Process prior on the transition function. These models have a natural interpretation as discretized stochastic differential equations, but inference for long sequences with fast and slow transitions is difficult. Fast transitions need tight discretizations whereas slow transitions require backpropagating the gradients over long subtrajectories. We propose a novel Gaussian process state-space architecture composed of multiple components, each trained on a different resolution, to model effects on different timescales. The combined model allows traversing time on adaptive scales, providing efficient inference for arbitrarily long sequences with complex dynamics. We benchmark our novel method on semi-synthetic data and on an engine modeling task. In both experiments, our approach compares favorably against its state-of-the-art alternatives that operate on a single time-scale only.

Learning Partially Known Stochastic Dynamics with Empirical PAC Bayes

We propose a novel scheme for fitting heavily parameterized non-linear stochastic differential equations (SDEs). We assign a prior on the parameters of the SDE drift and diffusion functions to achieve a Bayesian model. We then infer this model using the well-known local reparameterized trick for the first time for empirical Bayes, i.e. to integrate out the SDE parameters. The model is then fit by maximizing the likelihood of the resultant marginal with respect to a potentially large number of hyperparameters, which prohibits stable training. As the prior parameters are marginalized, the model also no longer provides a principled means to incorporate prior knowledge. We overcome both of these drawbacks by deriving a training loss that comprises the marginal likelihood of the predictor and a PAC-Bayesian complexity penalty. We observe on synthetic as well as real-world time series prediction tasks that our method provides an improved model fit accompanied with favorable extrapolation properties when provided a partial description of the environment dynamics. Hence, we view the outcome as a promising attempt for building cutting-edge hybrid learning systems that effectively combine first-principle physics and data-driven approaches.